Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL1801204

AZD-8055
Phase I
Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
Phase I
COc1ccc(-c2ccc3c(N4CCOC[C@@H]4C)nc(N4CCOC[C@@H]4C)nc3n2)cc1CO
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1801204
Name AZD-8055
Phase Phase I
Structure Type MOL
InChI Key KVLFRAWTRWDEDF-IRXDYDNUSA-N

Known Names

AZ-12600000 AZD 8055 Azd-8055 AZD8055
558
Targets
595
Activities
3
Assay Types
13
PK Parameters
20
Publications
4
Known Names
8
Indications
1
Mechanisms

Molecular Properties

465.6
MW (Da)
2.64
ALogP
9
HBA
1
HBD
93.1
PSA (Ų)
0.61
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Single Enantiomer

Flags

Natural Product Chemical Probe

Extended Properties

Molecular Formula C25H31N5O4
MW 465.55
Aromatic Rings 3
Heavy Atoms 34
NP-Likeness -0.51

Mechanism of Action

Mechanism Action Type Target Direct Efficacy
Serine/threonine-protein kinase mTOR inhibitor INHIBITOR Serine/threonine-protein kinase mTOR ✓ ✓

Indications

Astrocytoma Carcinoma, Hepatocellular Glioblastoma Lymphoma Neoplasms Neoplasms Oligodendroglioma Paraganglioma

Activity Summary

IC50 587 meas. best 9.89
EC50 7 meas. best 9.15
Kd 1 meas. best 5.16

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Serine/threonine-protein kinase mTOR
CHEMBL2842
 IC50 9.89 8.895 0.1 10
NON-PROTEIN TARGET
CHEMBL3879801
 EC50 9.15 9.15 0.7 7
mTORC1
CHEMBL4296661
 IC50 9.1 8.335 0.8 2
mTORC2
CHEMBL4523999
 IC50 8.55 8.55 2.8 1
NCI-H460
CHEMBL396
 IC50 8.0 7.15 10.0 2
U-87 MG
CHEMBL614247
 IC50 7.67 6.38 21.2 2
LU-139
CHEMBL2366248
 IC50 7.63 7.63 23.3 1
Unchecked
CHEMBL612545
 IC50 7.62 7.3825 24.0 4
MCF7
CHEMBL387
 IC50 7.57 6.9367 27.0 3
NCI-H720
CHEMBL2366105
 IC50 7.53 7.53 29.4 1
KARPAS-45
CHEMBL2366305
 IC50 7.47 7.47 33.7 1
PC-3
CHEMBL390
 IC50 7.43 6.785 36.7 2
EW-3
CHEMBL2366307
 IC50 7.39 7.39 40.6 1
SBC-1
CHEMBL2366327
 IC50 7.34 7.34 45.8 1
A549
CHEMBL392
 IC50 7.3 7.005 50.0 2
NCI-H209
CHEMBL2366365
 IC50 7.26 7.26 54.5 1
SK-OV-3
CHEMBL614925
 IC50 7.26 6.715 55.0 2
EOL1
CHEMBL614489
 IC50 7.18 7.18 65.7 1
H9
CHEMBL614806
 IC50 7.17 7.17 66.9 1
AN3-CA
CHEMBL1075392
 IC50 7.1 7.1 79.5 1
HH
CHEMBL2366310
 IC50 7.1 7.1 80.1 1
DU-4475
CHEMBL2366246
 IC50 7.09 7.09 80.5 1
KU812 cell line
CHEMBL613997
 IC50 7.09 7.09 80.4 1
CTV-1
CHEMBL2366360
 IC50 7.06 7.06 86.4 1
BV-173
CHEMBL2366145
 IC50 7.04 7.04 90.6 1
ES5
CHEMBL2366312
 IC50 7.03 7.03 93.5 1
G-402
CHEMBL1075446
 IC50 7.0 7.0 99.8 1
MV4-11
CHEMBL613835
 IC50 6.99 6.99 103.5 1
A-375
CHEMBL613859
 IC50 6.92 6.52 120.0 2
EGI-1
CHEMBL1075442
 IC50 6.87 6.87 135.3 1
NB69
CHEMBL1075510
 IC50 6.87 6.87 135.0 1
EW-18
CHEMBL2366097
 IC50 6.85 6.85 140.7 1
ME-180
CHEMBL1075499
 IC50 6.83 6.83 146.8 1
D283 Med
CHEMBL614476
 IC50 6.83 6.83 147.2 1
NB14
CHEMBL2366212
 IC50 6.78 6.78 164.5 1
NBsusSR
CHEMBL2366150
 IC50 6.77 6.77 170.2 1
Ramos-2G6-4C10
CHEMBL2366170
 IC50 6.77 6.77 169.8 1
LAMA-84
CHEMBL2366090
 IC50 6.74 6.74 180.3 1
NCI-H1581
CHEMBL1075516
 IC50 6.72 6.72 189.7 1
A204
CHEMBL614514
 IC50 6.72 6.72 189.7 1
CAL-51
CHEMBL1075411
 IC50 6.71 6.71 196.5 1
NKM-1
CHEMBL2366133
 IC50 6.7 6.7 200.3 1
LoVo
CHEMBL614721
 IC50 6.7 6.7 202.0 1
HAL-01
CHEMBL2366142
 IC50 6.69 6.69 203.0 1
HCC2218
CHEMBL2366221
 IC50 6.68 6.68 206.9 1
BEN
CHEMBL1075395
 IC50 6.67 6.67 212.9 1
LC-2-ad
CHEMBL2366260
 IC50 6.66 6.66 220.8 1
LXF-289 cell line
CHEMBL614107
 IC50 6.6 6.6 250.4 1
HGC-27
CHEMBL1075463
 IC50 6.58 6.58 264.1 1
LK-2
CHEMBL1075490
 IC50 6.57 6.57 268.2 1

Pharmacokinetic Data

Parameter Value Units Species
AUC 857.0 ng.hr.mL-1 Canis lupus familiaris
CL 42.8 mL.min-1.kg-1 Mus musculus
CL 36.6 mL.min-1.kg-1 Rattus norvegicus
CL 28.1 mL.min-1.g-1 Homo sapiens
Cmax 618.62 nM Canis lupus familiaris
F 81.0 % Mus musculus
F 12.0 % Rattus norvegicus
Fu 0.13 - Homo sapiens
Fu 0.08 - Rattus norvegicus
Fu 0.04 - Mus musculus
MRT 4.3 hr Canis lupus familiaris
T1/2 0.515 hr Homo sapiens
T1/2 5.4 hr Canis lupus familiaris

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Serine/threonine-protein kinase mTOR IC50 = 0.13 nM 9.89 Inhibition of mTOR (unknown origin) 36503229
Serine/threonine-protein kinase mTOR IC50 = 0.13 nM 9.89 Inhibition of recombinant FLAG-tagged mTOR (1362 to 2549) (unknown origin) expre... 23375793
NON-PROTEIN TARGET EC50 = 0.7 nM 9.15 Cytotoxicity against human Glioma cells (HF2885) after 72 hrs by CelltiterGlo as... 26288699
NON-PROTEIN TARGET EC50 = 0.7 nM 9.15 Cytotoxicity against human Glioma cells (HF3013) after 72 hrs by CelltiterGlo as... 26288699
NON-PROTEIN TARGET EC50 = 0.7 nM 9.15 Cytotoxicity against human Glioma cells (HF2303) after 72 hrs by CelltiterGlo as... 26288699
NON-PROTEIN TARGET EC50 = 0.7 nM 9.15 Cytotoxicity against human Glioma cells (HF2476) after 72 hrs by CelltiterGlo as... 26288699
NON-PROTEIN TARGET EC50 = 0.7 nM 9.15 Cytotoxicity against human Glioma cells (HF2381) after 72 hrs by CelltiterGlo as... 26288699
NON-PROTEIN TARGET EC50 = 0.7 nM 9.15 Cytotoxicity against human Glioma cells (HF2876) after 72 hrs by CelltiterGlo as... 26288699
NON-PROTEIN TARGET EC50 = 0.7 nM 9.15 Cytotoxicity against human Glioma cells (HF2790) after 72 hrs by CelltiterGlo as... 26288699
Serine/threonine-protein kinase mTOR IC50 = 0.8 nM 9.1 Inhibition of mTOR 20561789
mTORC1 IC50 = 0.8 nM 9.1 Inhibition of mTORC1 (unknown origin) 29211480
Serine/threonine-protein kinase mTOR IC50 = 0.8 nM 9.1 Inhibition of full length mTOR in human HeLa cells using 4EBP1 as substrate by i... 32966896
Serine/threonine-protein kinase mTOR IC50 = 0.8 nM 9.1 Inhibition of full-length human mTOR by immunoprecipitation method 36462440
Serine/threonine-protein kinase mTOR IC50 = 0.8 nM 9.1 Inhibition of mTOR (unknown origin) 38432059
mTORC2 IC50 = 2.8 nM 8.55 Inhibition of mTORC2 (unknown origin) 29211480
Serine/threonine-protein kinase mTOR IC50 = 4.0 nM 8.4 Inhibition of human N-terminal FLAG-tagged mTOR (1362-end residues) in presence ... 28235701
Serine/threonine-protein kinase mTOR IC50 = 6.0 nM 8.22 Inhibition of mTOR (unknown origin) by kinase profiling assay 35987020
Serine/threonine-protein kinase mTOR IC50 = 8.0 nM 8.1 Inhibition of mTOR (unknown origin) using ULight-4E-BP1 peptide substrate measur... 29945756
Serine/threonine-protein kinase mTOR IC50 = 8.9 nM 8.05 Alternative Enzyme Assay: The assay used AlphaScreen technology (Gray et al., An... -
NCI-H460 IC50 = 10.0 nM 8.0 Antiproliferative activity against human NCI-H460 cells after 72 hrs by SRB assa... 28235701

Literature References

PubMed DOI Target Context # Activities
26288699 10.1021/acsmedchemlett.5b00128 NON-PROTEIN TARGET 11
29191878 10.1126/science.aan4368 Unchecked 5
23375793 10.1016/j.bmcl.2013.01.019 Mus musculus 4
- 10.6019/CHEMBL4495565 SARS-CoV-2 4
26288699 10.1021/acsmedchemlett.5b00128 Unchecked 4
29945756 10.1016/j.bmc.2018.06.025 Canis familiaris 4
30292171 10.1016/j.isci.2018.09.012 U2OS 4
23375793 10.1016/j.bmcl.2013.01.019 Plasma 3
25643210 10.1021/jm501778s Unchecked 2
29945756 10.1016/j.bmc.2018.06.025 ADMET 2
25177796 10.1042/bj20140889 Serine/threonine-protein kinase mTOR 2
29945756 10.1016/j.bmc.2018.06.025 U-87 MG 2
- 10.6019/CHEMBL4651402 SARS-CoV-2 2
35987020 10.1016/j.ejmech.2022.114674 Serine/threonine-protein kinase mTOR 2
23375793 10.1016/j.bmcl.2013.01.019 No relevant target 2
- 10.6019/CHEMBL4808148 Histone deacetylase 6 2
23375793 10.1016/j.bmcl.2013.01.019 Rattus norvegicus 2
23375793 10.1016/j.bmcl.2013.01.019 mTORC1 2
23375793 10.1016/j.bmcl.2013.01.019 Unchecked 2
28235701 10.1016/j.ejmech.2017.02.015 PI3-kinase p110-alpha/p85-alpha 2

Data from ChEMBL 36 via Core Engine